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  • simulation of protein folding and misfolding
  • simulation of protein DNA association
  • quantum dynamics of biological macromolecules and simulation of enzyme reactions
  • theory of proton transfer in proteins
  • simulation of huge conformational changes and allosteric effects in proteins
  • simulation of DNA in solution

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Fabeckstr. 36a, D-14195, Germany, Berlin-Dahlem
+49 30 838 54387
+49 30 838 56921 (Fax)


Protein Electrostatics 2016

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www.electrostatics-berlin.de


Selected publications

Journal Cover
J. Chem. Inf. Model. 2009, 49 (9), 2147-2151
Aysam Guerler, Connie Wang and E. W. Knapp


Journal Cover
J. Chem. Theory Comput. 2009, 5 (3), 659-673
Alok Juneja, Henning Riedesel, Milan Hodoscek and E. W. Knapp


Journal Cover
J. Comput. Chem. 2015, 36 (2)
Gegham Galstyan and E. W. Knapp


Journal Cover
J. Comput. Chem. 2015, 36(29)
Ilkay Sakalli and E. W. Knapp


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